Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 9/20 | 0.45 |
| ▸ | PDE4A | P27815 | 5/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.45 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.45 |
| ▸ | SOS1 | Q07889 | 9/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.42 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.42 |
| ▸ | KRAS | P01116 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL24735665 | 0.84 | SOS1 (0.54) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL24735663 | 0.84 | SOS1 (0.54) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL29125432 | 0.80 | SOS1 (0.47) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL29125430 | 0.80 | SOS1 (0.47) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL28868076 | 0.74 | ERBB2 (0.50) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL30211074 | 0.74 | ERBB2 (0.50) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL28868072 | 0.74 | ERBB2 (0.50) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL23521036 | 0.73 | SOS1 (0.53) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL29988475 | 0.73 | SOS1 (0.57) | PDE4DPDE4APDE4BPDE4CSOS1 | |
| SCHEMBL24736309 | 0.72 | PDE4D (0.45) | PDE4DPDE4APDE4BPDE4CSOS1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022262691-A1 | HETEROCYCLIC COMPOUNDS AS SOS1 INHIBITORS | BEIJING INNOCARE PHARMA TECH CO., LTD. (CN) | 2022-12-22 | — | — | WO | disclosed |